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CAS 1643330-62-4
Also known as: 1643330-62-4, 5-chloro-n-(4-(5-morpholino-6-oxo-3,6-dihydropyridin-1(2h)-yl)phenyl)pentanamide, V9yk56w8pq, 5-chloro-n-(4-(5,6-dihydro-3-(4-morpholinyl)-2-oxo-1(2h)-pyridinyl)phenyl)pentanamide, Pentanamide, 5-chloro-n-(4-(5,6-dihydro-3-(4-morpholinyl)-2-oxo-1(2h)-pyridinyl)phenyl)-, Unii-v9yk56w8pq
Molecular Formula
C20H26ClN3O3
Molecular Weight
391.9  g/mol
InChI Key
YWWKAVVYOWDKHS-UHFFFAOYSA-N
FDA UNII
V9YK56W8PQ

1 2D Structure

CAS 1643330-62-4

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
5-chloro-N-[4-(5-morpholin-4-yl-6-oxo-2,3-dihydropyridin-1-yl)phenyl]pentanamide
2.1.2 InChI
InChI=1S/C20H26ClN3O3/c21-10-2-1-5-19(25)22-16-6-8-17(9-7-16)24-11-3-4-18(20(24)26)23-12-14-27-15-13-23/h4,6-9H,1-3,5,10-15H2,(H,22,25)
2.1.3 InChI Key
YWWKAVVYOWDKHS-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CN(C(=O)C(=C1)N2CCOCC2)C3=CC=C(C=C3)NC(=O)CCCCCl
2.2 Other Identifiers
2.2.1 UNII
V9YK56W8PQ
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 1643330-62-4

2. 5-chloro-n-(4-(5-morpholino-6-oxo-3,6-dihydropyridin-1(2h)-yl)phenyl)pentanamide

3. V9yk56w8pq

4. 5-chloro-n-(4-(5,6-dihydro-3-(4-morpholinyl)-2-oxo-1(2h)-pyridinyl)phenyl)pentanamide

5. Pentanamide, 5-chloro-n-(4-(5,6-dihydro-3-(4-morpholinyl)-2-oxo-1(2h)-pyridinyl)phenyl)-

6. Unii-v9yk56w8pq

7. Schembl16730279

8. Cs-m2421

9. F19392

2.4 Create Date
2014-10-10
3 Chemical and Physical Properties
Molecular Weight 391.9 g/mol
Molecular Formula C20H26ClN3O3
XLogP32.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass391.1662694 g/mol
Monoisotopic Mass391.1662694 g/mol
Topological Polar Surface Area61.9 Ų
Heavy Atom Count27
Formal Charge0
Complexity541
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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Digital Content Digital Content
URL Supplier Web Content
540-37-4
Apixaban
At Infinium Pharmachem Pvt. Ltd., we are well focused to Iodine chemistry & this is the only core area of...
At Infinium Pharmachem Pvt. Ltd., we are well focused to Iodine chemistry & this is the only core area of ours. We are working as CRAMS, but our domain is very restricted to Iodine chemistry & it revolves around Iodine derivatives or Iodination. We manufacture & supply wide range of superior quality Iodine Derivatives & API Since 2003. We are also providing fully integrated customized services from R & D to Commercial scale manufacturing and packaging for our products to the Pharmaceutical,Agrochemical,Nutraceutical, Speciality Chemicals & various other chemical Industries.
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